6835-3928 Screening compound: 2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

6835-3928 Screening compound: 2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
6835-3928 Screening compound: 2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6835-3928
2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6835-3928

Molecular Formula

C24H21ClN2O2 (C24 H21 ClN2 O2)

Compound Name

2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

IUPAC name

4-(4-chlorophenyl)-7-(4-ethoxyphenyl)-8-oxa-56-diazatricyclo[7.4.0.0^{26}]trideca-1(9)41012-tetraene

SMILES

CCOc1ccc(C(N(C2C3)N=C3c(cc3)ccc3Cl)Oc3c2cccc3)cc1

InChI

InChI=1S/C24H21ClN2O2/c1-2-28-19-13-9-17(10-14-19)24-27-22(20-5-3-4-6-23(20)29-24)15-21(26-27)16-7-11-18(25)12-8-16/h3-14,22,24H,2,15H2,1H3

InChI Key

SDAMCNIMHRYSMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01542545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.9

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.254

Distribution Coefficient, logD

6.254

Water Solubility, LogSw

-6.55

Polar Surface Area

29.169

Acid Dissociation Constant (pKa)

17.24

Base Dissociation Constant (pKb)

2.65

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.80

6835-3928 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6835-3928 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6835-3928?
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What is the minimum amount of 6835-3928 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6835-3928
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6835-3928
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6835-3928 available by request